ChemSpider 2D Image | N-Butyl-N-(2-{[1-(2-chlorophenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-naphthamide | C30H33ClN4O2

N-Butyl-N-(2-{[1-(2-chlorophenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-naphthamide

  • Molecular FormulaC30H33ClN4O2
  • Average mass517.062 Da
  • Monoisotopic mass516.229187 Da
  • ChemSpider ID4211910

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2-Naphthalenecarboxamide, N-butyl-N-[2-[[1-(2-chlorophenyl)-3-(1,1-dimethylethyl)-1H-pyrazol-5-yl]amino]-2-oxoethyl]- [ACD/Index Name]
N-Butyl-N-(2-{[1-(2-chlorophényl)-3-(2-méthyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoéthyl)-2-naphtamide [French] [ACD/IUPAC Name]
N-Butyl-N-(2-{[1-(2-chlorophenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-naphthamide [ACD/IUPAC Name]
N-Butyl-N-(2-{[1-(2-chlorphenyl)-3-(2-methyl-2-propanyl)-1H-pyrazol-5-yl]amino}-2-oxoethyl)-2-naphthamid [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.2±0.1 g/cm3
Boiling Point: 717.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 104.9±3.0 kJ/mol
Flash Point: 387.7±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 150.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 7.47
ACD/LogD (pH 5.5): 6.41
ACD/BCF (pH 5.5): 43950.31
ACD/KOC (pH 5.5): 73284.59
ACD/LogD (pH 7.4): 6.41
ACD/BCF (pH 7.4): 43950.75
ACD/KOC (pH 7.4): 73285.31
Polar Surface Area: 67 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 43.9±7.0 dyne/cm
Molar Volume: 437.6±7.0 cm3

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